8-chloro-1-methyl-N-[3-(4-phenylpiperazin-1-yl)propyl]-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
Chemical Structure Depiction of
8-chloro-1-methyl-N-[3-(4-phenylpiperazin-1-yl)propyl]-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
8-chloro-1-methyl-N-[3-(4-phenylpiperazin-1-yl)propyl]-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | G541-1077 |
| Compound Name: | 8-chloro-1-methyl-N-[3-(4-phenylpiperazin-1-yl)propyl]-1,4-dihydro[1]benzothiopyrano[4,3-c]pyrazole-3-carboxamide |
| Molecular Weight: | 482.05 |
| Molecular Formula: | C25 H28 Cl N5 O S |
| Smiles: | Cn1c2c3cc(ccc3SCc2c(C(NCCCN2CCN(CC2)c2ccccc2)=O)n1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.7457 |
| logD: | 3.2018 |
| logSw: | -4.2452 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.059 |
| InChI Key: | CHDFAQAXLTXGMF-UHFFFAOYSA-N |